Modeling by threading (Tito software) Unconserved sides chains calculation (Scwrl software) Evaluation (QMean software)
Input alignment information:
Query sequence | MKFLHTADLHLGKIVSGVSMLAEQEY-----ILTQITQIAEEEQVDALILAGDLYDRAVPPADAVKVLNDILVKWNVELGIPIFAISGNHDSAERLAFGSQWYESSKLYMKGKCTSQFDGIPFMDAEVWLVPYHEPAIIRQAFADNSIRSFEDAMQAVTKQIRSKWDTSKAQILVGHAFVSGGIPSDSERQLAIGNVDRVSTDCFD--GFTYTALGHLHHPHAIRHPS--IFYSGSPLKYSFSEANDH----KSVRIVELEGKELISVTERFLTPKHDMRIISGTLAELTENLVENPDDFFQVNLMDEGALIDPMGKLRQFYPNILHLERKKQTLKETQDSFEEIMKKDDLELFGQFFEHVNGTELTETQKQKLADVFEQARKEDAE |
3AUZ Chain:A ((21-254)) | MMFVHIADNHLGYRQYNLDDREKDIYDSFKLCIKKILEI----KPDVVLHSGDLFNDLRPPVKALRIAMQAFKKLH-ENNIKVYIVAGNHEMPRRLG------EESPLALLKDYVKILDG-----KDVINVNGEEIFICGTYYHKKSKR---EEMLDKLKNFESEAKNYKKKILMLHQGINPYIPLDYE------------LEHFDLPKFSYYALGHIHKRILERFNDGILAYSGSTEIIYRNEYEDYKKEGKGFYLVDFSGNDL-------------------------------------------------------------------------------------------------------------------------- |
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General information:
TITO was launched using:
| RESULT:
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Template: 3AUZ.pdb
Alignment : align.pir
Tito was launched with SMD and SCWRL
Tito text output
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3D Compatibility (PKB) -110663 for 1763 contacts (-62.8/contact) +
2D Compatibility (PS) -24014 + (NN) -8236 + (LL) 11536
1D Compatibility (HY) -11600 + (ID) 3400
Total energy: -146377.0 ( -83.03 by residue)
QMean score : 0.347
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